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Compile Data Set for Download or QSAR

Found 227 hits with Last Name = 'koczurkiewicz' and Initial = 'p'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291284
PNG
(CHEMBL4170220)
Show SMILES CN([C@@H]1CCCc2cc(ccc12)S(=O)(=O)c1cccc(F)c1)C(N)=O |r|
Show InChI InChI=1S/C18H19FN2O3S/c1-21(18(20)22)17-7-2-4-12-10-15(8-9-16(12)17)25(23,24)14-6-3-5-13(19)11-14/h3,5-6,8-11,17H,2,4,7H2,1H3,(H2,20,22)/t17-/m1/s1
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PubMed
0.200n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6R (unknown origin)


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50318633
PNG
(3-benzenesulfonyl-8-piperazin-1-ylquinoline | CHEM...)
Show SMILES O=S(=O)(c1ccccc1)c1cnc2c(cccc2c1)N1CCNCC1
Show InChI InChI=1S/C19H19N3O2S/c23-25(24,16-6-2-1-3-7-16)17-13-15-5-4-8-18(19(15)21-14-17)22-11-9-20-10-12-22/h1-8,13-14,20H,9-12H2
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0.280n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6R (unknown origin)


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50174269
PNG
(1-(phenylsulfonyl)-4-(piperazin-1-yl)-1H-indole | ...)
Show SMILES O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCNCC1
Show InChI InChI=1S/C18H19N3O2S/c22-24(23,15-5-2-1-3-6-15)21-12-9-16-17(7-4-8-18(16)21)20-13-10-19-11-14-20/h1-9,12,19H,10-11,13-14H2
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0.300n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cells measured after 1 hr by microbeta plate reader method


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112765
BindingDB Entry DOI: 10.7270/Q2ZC86K7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291286
PNG
(CHEMBL4169827)
Show SMILES O=S(=O)(c1ccccc1)n1ncc2c(cccc12)N1CCNCC1
Show InChI InChI=1S/C17H18N4O2S/c22-24(23,14-5-2-1-3-6-14)21-17-8-4-7-16(15(17)13-19-21)20-11-9-18-10-12-20/h1-8,13,18H,9-12H2
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0.300n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6R (unknown origin)


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50044615
PNG
(CHEMBL3329435)
Show SMILES Cc1nc2c(cccc2n1S(=O)(=O)c1ccccc1)N1CCNCC1
Show InChI InChI=1S/C18H20N4O2S/c1-14-20-18-16(21-12-10-19-11-13-21)8-5-9-17(18)22(14)25(23,24)15-6-3-2-4-7-15/h2-9,19H,10-13H2,1H3
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0.5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to 5HT6R (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50019754
PNG
(IDALOPIRDINE | LU-AE58054)
Show SMILES FC(F)C(F)(F)COc1cccc(CNCCc2c[nH]c3cc(F)ccc23)c1
Show InChI InChI=1S/C20H19F5N2O/c21-15-4-5-17-14(11-27-18(17)9-15)6-7-26-10-13-2-1-3-16(8-13)28-12-20(24,25)19(22)23/h1-5,8-9,11,19,26-27H,6-7,10,12H2
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0.830n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6R (unknown origin)


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50174269
PNG
(1-(phenylsulfonyl)-4-(piperazin-1-yl)-1H-indole | ...)
Show SMILES O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCNCC1
Show InChI InChI=1S/C18H19N3O2S/c22-24(23,15-5-2-1-3-6-15)21-12-9-16-17(7-4-8-18(16)21)20-13-10-19-11-14-20/h1-9,12,19H,10-11,13-14H2
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1n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6R (unknown origin)


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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1n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to 5-HT1A (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2020.127325
BindingDB Entry DOI: 10.7270/Q21V5JP1
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562751
PNG
(CHEMBL4760545)
Show SMILES CC(C)c1nc2c(nccc2n1S(=O)(=O)c1cccc(F)c1)N1CCNCC1
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1n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562748
PNG
(CHEMBL4760105)
Show SMILES CCc1nc2c(nccc2n1S(=O)(=O)c1cccc(F)c1)N1CCNCC1
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1n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562747
PNG
(CHEMBL4756814)
Show SMILES CCc1nc2c(nccc2n1S(=O)(=O)c1cccc(Cl)c1)N1CCNCC1
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1n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50318633
PNG
(3-benzenesulfonyl-8-piperazin-1-ylquinoline | CHEM...)
Show SMILES O=S(=O)(c1ccccc1)c1cnc2c(cccc2c1)N1CCNCC1
Show InChI InChI=1S/C19H19N3O2S/c23-25(24,16-6-2-1-3-7-16)17-13-15-5-4-8-18(19(15)21-14-17)22-11-9-20-10-12-22/h1-8,13-14,20H,9-12H2
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1.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50318633
PNG
(3-benzenesulfonyl-8-piperazin-1-ylquinoline | CHEM...)
Show SMILES O=S(=O)(c1ccccc1)c1cnc2c(cccc2c1)N1CCNCC1
Show InChI InChI=1S/C19H19N3O2S/c23-25(24,16-6-2-1-3-7-16)17-13-15-5-4-8-18(19(15)21-14-17)22-11-9-20-10-12-22/h1-8,13-14,20H,9-12H2
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1.40n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM10989
PNG
((1R)-N-(prop-2-yn-1-yl)-2,3-dihydro-1H-inden-1-ami...)
Show SMILES C#CCN[C@@H]1CCc2ccccc12 |r|
Show InChI InChI=1S/C12H13N/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12/h1,3-6,12-13H,7-9H2/t12-/m1/s1
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1.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cells measured after 1 hr by microbeta plate reader method


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112765
BindingDB Entry DOI: 10.7270/Q2ZC86K7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562744
PNG
(CHEMBL4777550)
Show SMILES Clc1cccc(c1)S(=O)(=O)n1cnc2c(nccc12)N1CCNCC1
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2n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562749
PNG
(CHEMBL4756098)
Show SMILES CC(C)c1nc2c(nccc2n1S(=O)(=O)c1ccccc1)N1CCNCC1
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2n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50274767
PNG
(CHEMBL4125735)
Show SMILES Clc1cccc(c1)S(=O)(=O)n1ccc2c(N[C@H]3CCNC3)nc3ccccc3c12 |r|
Show InChI InChI=1S/C21H19ClN4O2S/c22-14-4-3-5-16(12-14)29(27,28)26-11-9-18-20(26)17-6-1-2-7-19(17)25-21(18)24-15-8-10-23-13-15/h1-7,9,11-12,15,23H,8,10,13H2,(H,24,25)/t15-/m0/s1
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3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2022.114329
BindingDB Entry DOI: 10.7270/Q2RF6040
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562750
PNG
(CHEMBL4742804)
Show SMILES CC(C)c1nc2c(nccc2n1S(=O)(=O)c1cccc(Cl)c1)N1CCNCC1
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3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562745
PNG
(CHEMBL4743983)
Show SMILES Fc1cccc(c1)S(=O)(=O)n1cnc2c(nccc12)N1CCNCC1
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3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562743
PNG
(CHEMBL4759927)
Show SMILES O=S(=O)(c1ccccc1)n1cnc2c(nccc12)N1CCNCC1
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3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291287
PNG
(CHEMBL4177024)
Show SMILES O=S(=O)(c1ccccc1)n1ncc2c(nccc12)N1CCNCC1
Show InChI InChI=1S/C16H17N5O2S/c22-24(23,13-4-2-1-3-5-13)21-15-6-7-18-16(14(15)12-19-21)20-10-8-17-9-11-20/h1-7,12,17H,8-11H2
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5n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6R (unknown origin)


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291285
PNG
(CHEMBL4161904)
Show SMILES O=S(=O)(c1ccccc1)n1ccc2c(nccc12)N1CCNCC1
Show InChI InChI=1S/C17H18N4O2S/c22-24(23,14-4-2-1-3-5-14)21-11-7-15-16(21)6-8-19-17(15)20-12-9-18-10-13-20/h1-8,11,18H,9-10,12-13H2
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5n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6R (unknown origin)


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291208
PNG
(CHEMBL4175829)
Show SMILES CCc1nc2c(ccnc2n1Cc1cccc(F)c1)N1CCNCC1
Show InChI InChI=1S/C19H22FN5/c1-2-17-23-18-16(24-10-8-21-9-11-24)6-7-22-19(18)25(17)13-14-4-3-5-15(20)12-14/h3-7,12,21H,2,8-11,13H2,1H3
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6n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to 5HT6R (unknown origin)


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291208
PNG
(CHEMBL4175829)
Show SMILES CCc1nc2c(ccnc2n1Cc1cccc(F)c1)N1CCNCC1
Show InChI InChI=1S/C19H22FN5/c1-2-17-23-18-16(24-10-8-21-9-11-24)6-7-22-19(18)25(17)13-14-4-3-5-15(20)12-14/h3-7,12,21H,2,8-11,13H2,1H3
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6n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291262
PNG
(CHEMBL4164541)
Show SMILES CCc1nc2c(ccnc2n1Cc1cccc(Cl)c1)N1CCNCC1
Show InChI InChI=1S/C19H22ClN5/c1-2-17-23-18-16(24-10-8-21-9-11-24)6-7-22-19(18)25(17)13-14-4-3-5-15(20)12-14/h3-7,12,21H,2,8-11,13H2,1H3
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7n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50556389
PNG
(CHEMBL4784859)
Show SMILES Clc1cccc(Cn2ccc3c(cccc23)N2CCNCC2)c1
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7n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cells measured after 1 hr by microbeta plate reader method


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112765
BindingDB Entry DOI: 10.7270/Q2ZC86K7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562746
PNG
(CHEMBL4756605)
Show SMILES COc1cccc(c1)S(=O)(=O)n1cnc2c(nccc12)N1CCNCC1
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10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291266
PNG
(CHEMBL4169236)
Show SMILES CC(C)c1nc2c(ccnc2n1Cc1cccc(F)c1)N1CCNCC1
Show InChI InChI=1S/C20H24FN5/c1-14(2)19-24-18-17(25-10-8-22-9-11-25)6-7-23-20(18)26(19)13-15-4-3-5-16(21)12-15/h3-7,12,14,22H,8-11,13H2,1-2H3
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13n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562754
PNG
(CHEMBL4799851)
Show SMILES Clc1cccc(c1)S(=O)(=O)n1c(nc2c(nccc12)N1CCNCC1)-c1ccccc1
PDB

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17n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291267
PNG
(CHEMBL4161308)
Show SMILES CC(C)c1nc2c(ccnc2n1Cc1cccc(Cl)c1)N1CCNCC1
Show InChI InChI=1S/C20H24ClN5/c1-14(2)19-24-18-17(25-10-8-22-9-11-25)6-7-23-20(18)26(19)13-15-4-3-5-16(21)12-15/h3-7,12,14,22H,8-11,13H2,1-2H3
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20n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291132
PNG
(CHEMBL4161125)
Show SMILES Cc1nc2c(ccnc2n1Cc1cccc(Cl)c1)N1CCNCC1
Show InChI InChI=1S/C18H20ClN5/c1-13-22-17-16(23-9-7-20-8-10-23)5-6-21-18(17)24(13)12-14-3-2-4-15(19)11-14/h2-6,11,20H,7-10,12H2,1H3
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21n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562752
PNG
(CHEMBL4783584)
Show SMILES COc1cccc(c1)S(=O)(=O)n1c(nc2c(nccc12)N1CCNCC1)C(C)C
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23n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291089
PNG
(CHEMBL4172073)
Show SMILES Cc1nc2c(ccnc2n1Cc1cccc(C)c1)N1CCNCC1
Show InChI InChI=1S/C19H23N5/c1-14-4-3-5-16(12-14)13-24-15(2)22-18-17(6-7-21-19(18)24)23-10-8-20-9-11-23/h3-7,12,20H,8-11,13H2,1-2H3
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26n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50318633
PNG
(3-benzenesulfonyl-8-piperazin-1-ylquinoline | CHEM...)
Show SMILES O=S(=O)(c1ccccc1)c1cnc2c(cccc2c1)N1CCNCC1
Show InChI InChI=1S/C19H19N3O2S/c23-25(24,16-6-2-1-3-7-16)17-13-15-5-4-8-18(19(15)21-14-17)22-11-9-20-10-12-22/h1-8,13-14,20H,9-12H2
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26n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ketanserin from human 5HT2AR expressed in CHO-K1 cell membranes after 1.5 hrs by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50318633
PNG
(3-benzenesulfonyl-8-piperazin-1-ylquinoline | CHEM...)
Show SMILES O=S(=O)(c1ccccc1)c1cnc2c(cccc2c1)N1CCNCC1
Show InChI InChI=1S/C19H19N3O2S/c23-25(24,16-6-2-1-3-7-16)17-13-15-5-4-8-18(19(15)21-14-17)22-11-9-20-10-12-22/h1-8,13-14,20H,9-12H2
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26n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-8-OH-DPAT from human 5HT2A expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291272
PNG
(CHEMBL4160888)
Show SMILES CCC(CC)c1nc2c(ccnc2n1Cc1cccc(Cl)c1)N1CCNCC1
Show InChI InChI=1S/C22H28ClN5/c1-3-17(4-2)21-26-20-19(27-12-10-24-11-13-27)8-9-25-22(20)28(21)15-16-6-5-7-18(23)14-16/h5-9,14,17,24H,3-4,10-13,15H2,1-2H3
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30n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291288
PNG
(CHEMBL4170187)
Show SMILES Clc1cccc(Cn2cnc3c(ccnc23)N2CCNCC2)c1
Show InChI InChI=1S/C17H18ClN5/c18-14-3-1-2-13(10-14)11-23-12-21-16-15(4-5-20-17(16)23)22-8-6-19-7-9-22/h1-5,10,12,19H,6-9,11H2
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33n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291154
PNG
(CHEMBL4165620)
Show SMILES CCc1nc2c(ccnc2n1Cc1ccccc1)N1CCNCC1
Show InChI InChI=1S/C19H23N5/c1-2-17-22-18-16(23-12-10-20-11-13-23)8-9-21-19(18)24(17)14-15-6-4-3-5-7-15/h3-9,20H,2,10-14H2,1H3
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36n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562755
PNG
(CHEMBL4746063)
Show SMILES Fc1cccc(c1)S(=O)(=O)n1c(nc2c(nccc12)N1CCNCC1)-c1ccccc1
PDB

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37n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50556388
PNG
(CHEMBL4741978)
Show SMILES CN(CC#C)Cc1ccc(OCCCCCN2CCN(CC2)c2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1
PDB

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38n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cells measured after 1 hr by microbeta plate reader method


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112765
BindingDB Entry DOI: 10.7270/Q2ZC86K7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50562756
PNG
(CHEMBL4758494)
Show SMILES COc1cccc(c1)S(=O)(=O)n1c(nc2c(nccc12)N1CCNCC1)-c1ccccc1
PDB

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41n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes incubated for 1 hr by micro-beta plate reader based analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c02009
BindingDB Entry DOI: 10.7270/Q2JQ14RQ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291282
PNG
(CHEMBL4160798)
Show SMILES CCc1nc2c(ccnc2n1CCc1cccc(Cl)c1)N1CCNCC1
Show InChI InChI=1S/C20H24ClN5/c1-2-18-24-19-17(25-12-9-22-10-13-25)6-8-23-20(19)26(18)11-7-15-4-3-5-16(21)14-15/h3-6,8,14,22H,2,7,9-13H2,1H3
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42n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291273
PNG
(CHEMBL4171504)
Show SMILES CCC(CC)c1nc2c(ccnc2n1Cc1cccc(C)c1)N1CCNCC1
Show InChI InChI=1S/C23H31N5/c1-4-19(5-2)22-26-21-20(27-13-11-24-12-14-27)9-10-25-23(21)28(22)16-18-8-6-7-17(3)15-18/h6-10,15,19,24H,4-5,11-14,16H2,1-3H3
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42n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50556376
PNG
(CHEMBL4742220)
Show SMILES O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCOc2cccc3C(CCc23)NCC#C)CC1
PDB

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50n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cells measured after 1 hr by microbeta plate reader method


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112765
BindingDB Entry DOI: 10.7270/Q2ZC86K7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50556377
PNG
(CHEMBL4780498)
Show SMILES O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCCOc2cccc3C(CCc23)NCC#C)CC1
PDB

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51n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cells measured after 1 hr by microbeta plate reader method


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112765
BindingDB Entry DOI: 10.7270/Q2ZC86K7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50556387
PNG
(CHEMBL4761469)
Show SMILES CN(CC#C)Cc1ccc(OCCCCN2CCN(CC2)c2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1
PDB

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54n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-LSD from human 5HT6 receptor expressed in HEK293 cells measured after 1 hr by microbeta plate reader method


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112765
BindingDB Entry DOI: 10.7270/Q2ZC86K7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291281
PNG
(CHEMBL4174854)
Show SMILES CCc1nc2c(ccnc2n1CCc1cccc(F)c1)N1CCNCC1
Show InChI InChI=1S/C20H24FN5/c1-2-18-24-19-17(25-12-9-22-10-13-25)6-8-23-20(19)26(18)11-7-15-4-3-5-16(21)14-15/h3-6,8,14,22H,2,7,9-13H2,1H3
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56n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291263
PNG
(CHEMBL4172424)
Show SMILES CCc1nc2c(ccnc2n1Cc1cc(F)ccc1F)N1CCNCC1
Show InChI InChI=1S/C19H21F2N5/c1-2-17-24-18-16(25-9-7-22-8-10-25)5-6-23-19(18)26(17)12-13-11-14(20)3-4-15(13)21/h3-6,11,22H,2,7-10,12H2,1H3
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57n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291265
PNG
(CHEMBL4173960)
Show SMILES CC(C)c1nc2c(ccnc2n1Cc1ccccc1F)N1CCNCC1
Show InChI InChI=1S/C20H24FN5/c1-14(2)19-24-18-17(25-11-9-22-10-12-25)7-8-23-20(18)26(19)13-15-5-3-4-6-16(15)21/h3-8,14,22H,9-13H2,1-2H3
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61n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50291152
PNG
(CHEMBL4169050)
Show SMILES Cc1nc2c(ccnc2n1Cc1cccc(c1)C(F)(F)F)N1CCNCC1
Show InChI InChI=1S/C19H20F3N5/c1-13-25-17-16(26-9-7-23-8-10-26)5-6-24-18(17)27(13)12-14-3-2-4-15(11-14)19(20,21)22/h2-6,11,23H,7-10,12H2,1H3
PDB

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62n/an/an/an/an/an/an/an/a



Palack£ University

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5HT6R expressed in HEK293 cell membranes after 1 hr by microbeta counting method


Eur J Med Chem 144: 716-729 (2018)


Article DOI: 10.1016/j.ejmech.2017.12.053
BindingDB Entry DOI: 10.7270/Q2ZK5K6S
More data for this
Ligand-Target Pair
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